11-butyl-9-(cyclohexylmethyl)-4-(phenylmethyl)-4,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride

Systemtic Name: 11-butyl-9-(cyclohexylmethyl)-4-(phenylmethyl)-4,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride Openeye Name: 4-benzyl-11-butyl-9-(cyclohexylmethyl)-4,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride CAS Name: 11-butyl-9-(cyclohexylmethyl)-4-(phenylmethyl)-4,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride IUPAC Name: 4-benzyl-11-butyl-9-(cyclohexylmethyl)-4,8,11-triazaspiro[5.5]undecane-7,10-dione hydrochloride Traditional Name: 4-benzyl-11-butyl-9-(cyclohexylmethyl)-4,8,11-triazaspiro[5.5]undecane-7,10-quinone hydrochloride Formula: C26H40ClN3O2 MolecularWeight: 462.0677

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(NC(=O)C12CCCN(C2)CC3=CC=CC=C3)CC4CCCCC4.Cl

Isomeric SMILES

CCCCN1C(=O)C(NC(=O)C12CCCN(C2)CC3=CC=CC=C3)CC4CCCCC4.Cl

InChI

InChI=1S/C26H39N3O2.ClH/c1-2-3-17-29-24(30)23(18-21-11-6-4-7-12-21)27-25(31)26(29)15-10-16-28(20-26)19-22-13-8-5-9-14-22;/h5,8-9,13-14,21,23H,2-4,6-7,10-12,15-20H2,1H3,(H,27,31);1H